SMILES:
COc1ccc(C(C)C)cc1-c1ccc(C(F)(F)F)cc1CNMolecular Processing
Molecular formula
C18H20F3NO
Molecular weight
323.36
Exact mass
323.1497
XLogP
4.96
TPSA
35.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
85.41
Supplementary Information
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